#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1maj s VAL 2 N 0.00 3.10 0.64 2.12 1.01 -1.26 -4.94 120.40 121.07 1maj s VAL 2 Ca 0.00 0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 1maj s VAL 2 Cb 0.00 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 1maj s VAL 2 CO 0.00 -0.07 1.12 -0.69 0.00 0.00 0.00 175.10 175.47 1maj s VAL 3 N 7.34 3.13 -0.37 2.92 1.01 -1.26 -4.60 120.40 128.58 1maj s VAL 3 Ca 0.94 0.57 0.00 0.00 0.00 0.00 0.00 61.98 63.49 1maj s VAL 3 Cb -0.33 -3.11 0.13 0.00 0.00 0.00 0.00 36.38 33.07 1maj s VAL 3 CO 0.36 -0.28 0.19 -0.04 0.00 0.00 0.00 175.10 175.32 1maj s MET 4 N -3.89 0.79 -0.19 2.72 -1.94 -1.25 0.54 119.30 116.07 1maj s MET 4 Ca 0.69 -1.43 -0.29 0.00 -1.71 0.00 0.00 55.69 52.95 1maj s MET 4 Cb -0.22 -1.76 0.00 0.00 2.01 0.00 0.00 34.83 34.86 1maj s MET 4 CO 0.39 -1.13 1.07 0.99 -0.01 0.00 0.00 175.02 176.32 1maj s THR 5 N 1.04 4.63 -0.19 2.05 2.01 -0.54 -2.12 115.64 122.51 1maj s THR 5 Ca 0.15 1.95 -0.12 0.00 0.31 0.00 0.00 61.69 63.98 1maj s THR 5 Cb -0.22 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 67.99 1maj s THR 5 CO -0.08 -0.14 0.23 -1.58 -0.69 0.00 0.00 174.62 172.36 1maj s GLN 6 N 3.01 4.21 0.01 4.92 2.00 -1.26 -1.33 119.66 131.21 1maj s GLN 6 Ca 0.47 -0.05 -0.12 0.00 -2.00 0.00 0.00 55.36 53.65 1maj s GLN 6 Cb -0.17 -3.45 0.02 0.00 0.80 0.00 0.00 33.01 30.21 1maj s GLN 6 CO 0.10 0.21 0.26 0.95 -0.50 0.00 0.00 175.29 176.31 1maj s THR 7 N 0.57 0.07 1.12 -0.34 -4.23 -1.00 -4.53 115.64 107.32 1maj s THR 7 Ca 0.13 -0.61 -0.19 0.00 -1.18 0.00 0.00 61.69 59.83 1maj s THR 7 Cb -0.12 -0.68 0.27 0.00 1.34 0.00 0.00 72.50 73.30 1maj s THR 7 CO 0.02 -0.34 1.20 -0.81 -0.54 0.00 0.00 174.62 174.15 1maj n PRO 8 N 1.09 -2.35 0.08 3.99 -0.04 -1.26 0.15 135.00 136.67 1maj n PRO 8 Ca -0.21 -1.89 -0.11 0.00 -0.04 0.00 0.00 63.50 61.26 1maj n PRO 8 Cb 0.57 -1.53 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 1maj n PRO 8 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1maj h LEU 9 N 0.00 0.29 -8.52 1.53 4.07 -1.88 -3.40 115.31 107.40 1maj h LEU 9 Ca -0.42 -0.27 -0.40 0.00 0.08 0.00 0.00 57.88 56.87 1maj h LEU 9 Cb 1.23 -0.09 -0.19 0.00 1.08 0.00 0.00 40.66 42.68 1maj h LEU 9 CO 0.28 1.12 -0.76 -0.44 -1.08 0.00 0.00 178.44 177.57 1maj s SER 10 N -6.97 1.82 -0.41 -0.43 0.01 -1.26 0.15 113.70 106.61 1maj s SER 10 Ca -0.03 -0.75 0.07 0.00 1.31 0.00 0.00 55.95 56.55 1maj s SER 10 Cb 0.09 -0.05 0.22 0.00 0.21 0.00 0.00 66.02 66.49 1maj s SER 10 CO 0.85 -0.14 0.52 -0.11 0.41 0.00 0.00 173.24 174.77 1maj n LEU 11 N 0.79 -0.57 -4.58 2.44 7.94 0.27 -4.86 117.00 118.42 1maj n LEU 11 Ca -0.17 -4.34 -0.41 0.00 -1.11 0.00 0.00 56.01 49.97 1maj n LEU 11 Cb 0.56 0.64 -0.03 0.00 0.53 0.00 0.00 43.42 45.12 1maj n LEU 11 CO 0.25 1.99 1.61 -2.16 -1.11 0.00 0.00 177.39 177.97 1maj s PRO 12 N -0.48 3.05 0.29 1.96 0.04 -1.25 -3.30 135.00 135.30 1maj s PRO 12 Ca 0.34 1.25 0.02 0.00 0.04 0.00 0.00 61.00 62.65 1maj s PRO 12 Cb 0.13 -4.29 -0.05 0.00 0.04 0.00 0.00 34.50 30.33 1maj s PRO 12 CO -0.15 -2.20 0.09 0.14 0.04 0.00 0.00 177.00 174.92 1maj s VAL 13 N 7.94 0.75 0.07 -0.36 -7.23 -0.62 -4.66 120.40 116.30 1maj s VAL 13 Ca 0.79 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.96 1maj s VAL 13 Cb -0.20 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 1maj s VAL 13 CO 0.30 0.00 0.23 -0.44 -0.31 0.00 0.00 175.10 174.88 1maj s SER 14 N -3.38 6.37 -0.93 4.85 0.01 -1.26 0.19 113.70 119.55 1maj s SER 14 Ca 0.37 0.30 -0.24 0.00 1.31 0.00 0.00 55.95 57.69 1maj s SER 14 Cb 0.08 -1.97 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 1maj s SER 14 CO 0.14 0.15 1.75 -0.76 0.41 0.00 0.00 173.24 174.93 1maj s LEU 15 N -2.57 3.29 0.00 2.44 1.43 -1.26 -2.15 118.68 119.87 1maj s LEU 15 Ca 0.36 -0.92 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1maj s LEU 15 Cb -0.13 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1maj s LEU 15 CO 0.28 -2.26 0.00 0.61 0.23 0.00 0.00 176.35 175.21 1maj n GLY 16 N 6.80 0.55 0.00 -3.19 0.00 0.13 -4.90 105.19 104.58 1maj n GLY 16 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1maj n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1maj n ASP 17 N 0.00 0.00 -4.43 1.61 8.00 -0.91 -4.53 116.55 116.29 1maj n ASP 17 Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 1maj n ASP 17 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1maj n ASP 17 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1maj s GLN 18 N 0.81 1.56 0.10 -1.24 -0.21 -1.26 -0.60 119.66 118.82 1maj s GLN 18 Ca 0.00 -1.79 0.01 0.00 0.02 0.00 0.00 55.36 53.60 1maj s GLN 18 Cb 0.00 -1.20 -0.04 0.00 1.00 0.00 0.00 33.01 32.77 1maj s GLN 18 CO 0.00 0.05 -0.04 0.00 -2.12 0.00 0.00 175.29 173.18 1maj s ALA 19 N -2.98 0.91 -0.33 6.09 0.00 -0.89 -4.88 121.76 119.68 1maj s ALA 19 Ca 0.29 -1.36 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1maj s ALA 19 Cb 0.03 0.29 0.15 0.00 0.00 0.00 0.00 23.12 23.59 1maj s ALA 19 CO 0.12 -0.30 0.39 -1.12 0.00 0.00 0.00 175.76 174.85 1maj s SER 20 N -3.03 0.85 -0.07 0.00 0.01 -1.26 -1.09 113.70 109.11 1maj s SER 20 Ca 0.13 -0.98 -0.18 0.00 1.31 0.00 0.00 55.95 56.23 1maj s SER 20 Cb 0.06 0.81 -0.05 0.00 0.21 0.00 0.00 66.02 67.06 1maj s SER 20 CO -0.04 -0.31 0.49 -0.63 0.41 0.00 0.00 173.24 173.15 1maj s ILE 21 N 2.00 5.09 0.38 1.44 1.09 -0.36 -4.74 121.20 126.10 1maj s ILE 21 Ca 0.13 0.99 -0.02 0.00 -1.10 0.00 0.00 60.65 60.66 1maj s ILE 21 Cb -0.13 -3.82 -0.04 0.00 -1.06 0.00 0.00 42.46 37.41 1maj s ILE 21 CO -0.18 0.40 0.62 -0.55 -0.10 0.00 0.00 174.94 175.12 1maj s SER 22 N 0.10 6.30 -0.28 3.58 0.15 0.40 0.22 113.70 124.16 1maj s SER 22 Ca 0.27 0.62 0.01 0.00 0.70 0.00 0.00 55.95 57.54 1maj s SER 22 Cb -0.16 -2.11 0.17 0.00 -1.71 0.00 0.00 66.02 62.22 1maj s SER 22 CO 0.12 -0.37 0.51 0.00 1.20 0.00 0.00 173.24 174.70 1maj s ARG 24 N 2.72 4.02 0.23 0.00 1.81 -0.44 -1.70 118.95 125.59 1maj s ARG 24 Ca 0.14 -0.30 -0.15 0.00 -1.72 0.00 0.00 55.73 53.71 1maj s ARG 24 Cb -0.13 -3.49 -0.08 0.00 -0.45 0.00 0.00 34.95 30.80 1maj s ARG 24 CO -0.23 0.06 0.65 -1.54 -0.68 0.00 0.00 175.30 173.56 1maj s SER 25 N 1.05 6.83 0.02 0.23 1.04 -0.68 -1.47 113.70 120.72 1maj s SER 25 Ca 0.07 1.19 -0.06 0.00 0.48 0.00 0.00 55.95 57.63 1maj s SER 25 Cb -0.14 -2.33 -0.02 0.00 0.10 0.00 0.00 66.02 63.63 1maj s SER 25 CO 0.04 -0.04 1.10 0.28 0.98 0.00 0.00 173.24 175.60 1maj h SER 26 N 2.93 -0.31 -2.12 7.02 0.02 -0.16 -3.34 113.55 117.60 1maj h SER 26 Ca -0.48 0.04 -0.54 0.00 -0.84 0.00 0.00 61.79 59.97 1maj h SER 26 Cb 1.18 0.12 -0.41 0.00 0.14 0.00 0.00 62.40 63.43 1maj h SER 26 CO 0.66 -0.09 -0.89 1.67 -1.14 0.00 0.00 176.83 177.04 1maj n GLN 27 N -3.08 2.26 -1.36 3.45 0.00 -1.26 -4.96 117.38 112.43 1maj n GLN 27 Ca -0.01 -4.20 0.18 0.00 -0.00 0.00 0.00 57.00 52.97 1maj n GLN 27 Cb 0.07 -2.00 -0.06 0.00 0.00 0.00 0.00 30.24 28.26 1maj n GLN 27 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1maj n SER 28 N -0.03 -8.12 -0.43 1.69 2.88 -1.25 -4.76 113.62 103.59 1maj n SER 28 Ca 0.28 0.80 0.04 0.00 -1.33 0.00 0.00 58.87 58.67 1maj n SER 28 Cb 0.52 -4.28 0.06 0.00 -0.75 0.00 0.00 64.21 59.76 1maj n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1maj n LEU 29 N -4.14 1.07 -4.67 2.46 4.77 -1.24 -4.99 117.00 110.25 1maj n LEU 29 Ca -0.02 -1.99 -0.43 0.00 -0.03 0.00 0.00 56.01 53.54 1maj n LEU 29 Cb 0.63 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 1maj n LEU 29 CO 0.02 0.50 0.86 -0.69 -1.33 0.00 0.00 177.39 176.75 1maj s VAL 30 N -1.21 4.72 1.33 4.08 1.01 -1.26 -3.51 120.40 125.55 1maj s VAL 30 Ca 0.16 2.03 -0.22 0.00 0.00 0.00 0.00 61.98 63.95 1maj s VAL 30 Cb 0.15 -4.31 0.33 0.00 0.00 0.00 0.00 36.38 32.56 1maj s VAL 30 CO -0.01 -0.09 1.03 -2.28 0.00 0.00 0.00 175.10 173.76 1maj s HIS 31 N 2.61 -0.22 -1.27 5.22 2.46 0.06 -4.80 115.29 119.35 1maj s HIS 31 Ca 0.46 0.47 -0.09 0.00 0.47 0.00 0.00 55.06 56.38 1maj s HIS 31 Cb -0.17 -3.22 -0.07 0.00 -0.13 0.00 0.00 32.58 28.99 1maj s HIS 31 CO 0.12 -4.49 2.51 0.43 -2.47 0.00 0.00 174.74 170.84 1maj n SER 32 N -5.22 6.58 0.00 9.88 7.64 -1.26 -2.92 113.62 128.32 1maj n SER 32 Ca 0.14 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.54 1maj n SER 32 Cb 0.60 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 1maj n SER 32 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1maj n ASN 33 N 4.14 0.00 0.00 6.43 6.94 -1.26 -5.01 115.26 126.50 1maj n ASN 33 Ca 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.17 1maj n ASN 33 Cb 0.20 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.62 1maj n ASN 33 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1maj n GLY 34 N 0.00 0.67 3.05 4.83 0.00 -1.15 -5.12 105.19 107.47 1maj n GLY 34 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1maj n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1maj s ASN 35 N -1.33 4.59 0.02 1.61 -0.87 -1.26 -4.87 114.94 112.83 1maj s ASN 35 Ca 0.00 -1.75 -0.14 0.00 -1.57 0.00 0.00 52.86 49.40 1maj s ASN 35 Cb 0.00 -1.58 -0.06 0.00 -0.02 0.00 0.00 41.25 39.59 1maj s ASN 35 CO 0.00 -0.28 0.42 -0.89 -2.57 0.00 0.00 177.10 173.78 1maj s THR 36 N 1.01 5.02 0.16 1.60 2.01 -1.26 -0.76 115.64 123.42 1maj s THR 36 Ca 0.00 0.79 0.07 0.00 0.31 0.00 0.00 61.69 62.87 1maj s THR 36 Cb -0.20 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 1maj s THR 36 CO -0.06 0.52 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.93 1maj s TYR 37 N -1.15 1.60 -0.30 4.92 2.02 -1.19 -4.57 117.35 118.69 1maj s TYR 37 Ca 0.26 -0.55 -0.11 0.00 -0.37 0.00 0.00 57.07 56.29 1maj s TYR 37 Cb -0.16 -0.79 0.18 0.00 -0.40 0.00 0.00 41.96 40.78 1maj s TYR 37 CO 0.14 0.25 1.03 -1.17 -1.57 0.00 0.00 175.55 174.24 1maj s LEU 38 N -2.82 -0.50 -0.49 -1.29 0.20 0.19 -4.59 118.68 109.37 1maj s LEU 38 Ca 0.15 0.20 -0.18 0.00 0.69 0.00 0.00 54.13 55.00 1maj s LEU 38 Cb -0.03 1.37 0.06 0.00 -0.43 0.00 0.00 46.19 47.17 1maj s LEU 38 CO 0.05 -0.09 0.54 0.20 -0.29 0.00 0.00 176.35 176.75 1maj s ASN 39 N 2.95 6.19 0.32 3.68 -0.87 0.64 -2.29 114.94 125.56 1maj s ASN 39 Ca 0.10 -1.09 -0.17 0.00 -1.57 0.00 0.00 52.86 50.13 1maj s ASN 39 Cb -0.07 -2.25 -0.09 0.00 -0.02 0.00 0.00 41.25 38.82 1maj s ASN 39 CO -0.16 -0.80 0.76 0.26 -2.57 0.00 0.00 177.10 174.60 1maj s TRP 40 N 2.24 3.43 0.07 2.20 0.52 0.10 0.31 118.94 127.80 1maj s TRP 40 Ca 0.11 1.31 0.01 0.00 0.02 0.00 0.00 56.10 57.55 1maj s TRP 40 Cb -0.21 -2.60 -0.04 0.00 -1.15 0.00 0.00 33.47 29.47 1maj s TRP 40 CO 0.10 0.12 -0.06 0.71 0.02 0.00 0.00 176.95 177.84 1maj s TYR 41 N -1.91 0.75 -0.18 -1.98 2.02 -0.04 -2.59 117.35 113.43 1maj s TYR 41 Ca 0.53 -0.83 -0.04 0.00 -0.37 0.00 0.00 57.07 56.37 1maj s TYR 41 Cb -0.12 -0.45 0.06 0.00 -0.40 0.00 0.00 41.96 41.05 1maj s TYR 41 CO 0.18 -0.17 0.06 -1.17 -1.57 0.00 0.00 175.55 172.87 1maj s LEU 42 N -2.61 0.84 -0.25 -1.29 2.96 -0.17 -1.11 118.68 117.05 1maj s LEU 42 Ca 0.05 -0.71 -0.15 0.00 -0.22 0.00 0.00 54.13 53.10 1maj s LEU 42 Cb 0.01 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.21 1maj s LEU 42 CO -0.04 -0.32 0.36 -1.58 -1.32 0.00 0.00 176.35 173.45 1maj s GLN 43 N 1.97 4.06 0.67 1.98 2.00 -0.25 -1.06 119.66 129.03 1maj s GLN 43 Ca 0.00 0.05 -0.02 0.00 -2.00 0.00 0.00 55.36 53.40 1maj s GLN 43 Cb -0.16 -3.62 0.09 0.00 0.80 0.00 0.00 33.01 30.12 1maj s GLN 43 CO -0.08 -0.19 0.94 0.21 -0.50 0.00 0.00 175.29 175.67 1maj s LYS 44 N 1.79 2.01 -0.81 1.67 2.20 -1.26 0.44 119.74 125.78 1maj s LYS 44 Ca 0.15 -0.82 -0.24 0.00 -0.36 0.00 0.00 55.97 54.70 1maj s LYS 44 Cb -0.15 -2.33 -0.16 0.00 -1.51 0.00 0.00 37.83 33.67 1maj s LYS 44 CO 0.09 -1.21 2.39 0.00 -0.36 0.00 0.00 175.35 176.25 1maj n ALA 45 N -2.73 0.45 -2.72 3.13 0.00 -1.26 -2.01 120.51 115.37 1maj n ALA 45 Ca 0.11 -1.31 -0.08 0.00 0.00 0.00 0.00 53.44 52.17 1maj n ALA 45 Cb 0.60 -3.17 0.03 0.00 0.00 0.00 0.00 19.45 16.92 1maj n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1maj n GLY 46 N 6.62 0.23 3.17 0.00 0.00 -1.26 -5.05 105.19 108.90 1maj n GLY 46 Ca 0.50 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 1maj n GLY 46 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1maj s GLN 47 N -4.95 0.88 0.46 1.61 -0.44 -0.85 -5.13 119.66 111.23 1maj s GLN 47 Ca 0.10 -1.38 -0.24 0.00 -2.50 0.00 0.00 55.36 51.34 1maj s GLN 47 Cb -0.04 -0.10 -0.07 0.00 -1.64 0.00 0.00 33.01 31.15 1maj s GLN 47 CO 0.29 -0.09 1.28 0.45 0.50 0.00 0.00 175.29 177.72 1maj s SER 48 N -3.06 5.99 0.19 6.67 0.15 -1.26 -4.09 113.70 118.30 1maj s SER 48 Ca 0.15 2.59 -0.32 0.00 0.70 0.00 0.00 55.95 59.07 1maj s SER 48 Cb 0.06 -2.63 -0.11 0.00 -1.71 0.00 0.00 66.02 61.63 1maj s SER 48 CO -0.03 -1.06 1.65 -2.16 1.20 0.00 0.00 173.24 172.84 1maj s PRO 49 N -2.55 4.17 -0.18 5.44 0.04 -1.26 -4.53 135.00 136.12 1maj s PRO 49 Ca 0.63 2.49 -0.11 0.00 0.04 0.00 0.00 61.00 64.05 1maj s PRO 49 Cb -0.36 -3.11 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 1maj s PRO 49 CO 0.45 -0.68 0.17 0.15 0.04 0.00 0.00 177.00 177.13 1maj s LYS 50 N 1.13 4.16 0.06 4.56 -0.14 -0.22 -4.79 119.74 124.50 1maj s LYS 50 Ca 0.72 -0.13 -0.24 0.00 -1.36 0.00 0.00 55.97 54.96 1maj s LYS 50 Cb -0.47 -3.41 -0.06 0.00 -1.68 0.00 0.00 37.83 32.22 1maj s LYS 50 CO 0.32 0.32 0.74 -1.17 -0.76 0.00 0.00 175.35 174.79 1maj s LEU 51 N 0.29 4.47 0.06 3.17 2.96 -1.26 -1.00 118.68 127.38 1maj s LEU 51 Ca 0.11 1.44 0.00 0.00 -0.22 0.00 0.00 54.13 55.45 1maj s LEU 51 Cb -0.12 -3.19 0.00 0.00 0.50 0.00 0.00 46.19 43.38 1maj s LEU 51 CO -0.00 0.07 0.00 0.18 -1.32 0.00 0.00 176.35 175.28 1maj n LEU 52 N 2.54 0.61 -4.46 -0.68 4.77 -1.07 -4.75 117.00 113.96 1maj n LEU 52 Ca -0.04 0.08 -0.25 0.00 -0.03 0.00 0.00 56.01 55.78 1maj n LEU 52 Cb 0.50 -0.18 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 1maj n LEU 52 CO 0.46 -0.43 -0.49 -0.63 -1.33 0.00 0.00 177.39 174.97 1maj s ILE 53 N -2.00 2.43 0.00 -0.08 -1.09 -1.26 0.03 121.20 119.23 1maj s ILE 53 Ca 0.00 -2.31 0.00 0.00 -2.23 0.00 0.00 60.65 56.11 1maj s ILE 53 Cb 0.00 -2.25 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 1maj s ILE 53 CO 0.00 -0.33 0.00 0.00 -1.23 0.00 0.00 174.94 173.38 1maj n TYR 54 N -0.38 0.00 -0.12 3.97 0.18 -0.97 -0.72 117.16 119.11 1maj n TYR 54 Ca -0.07 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.45 1maj n TYR 54 Cb 0.59 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.46 1maj n TYR 54 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 1maj n LYS 55 N -0.55 0.54 0.00 -3.48 4.81 -1.20 -0.64 118.16 117.65 1maj n LYS 55 Ca 0.00 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1maj n LYS 55 Cb 0.04 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 33.67 1maj n LYS 55 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1maj n VAL 56 N -4.20 0.00 0.00 3.15 3.14 -1.26 -1.93 118.33 117.23 1maj n VAL 56 Ca -0.46 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 60.92 1maj n VAL 56 Cb 0.82 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.60 1maj n VAL 56 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1maj n SER 57 N -0.83 0.37 -4.67 6.55 2.88 -1.20 -2.47 113.62 114.24 1maj n SER 57 Ca 0.00 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 57.08 1maj n SER 57 Cb 0.00 0.03 -0.04 0.00 -0.75 0.00 0.00 64.21 63.45 1maj n SER 57 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1maj n ASN 58 N -0.79 3.76 -4.84 -3.46 5.03 -1.26 -4.09 115.26 109.61 1maj n ASN 58 Ca 0.00 0.94 -0.32 0.00 0.87 0.00 0.00 54.58 56.08 1maj n ASN 58 Cb 0.04 -1.44 0.01 0.00 -1.02 0.00 0.00 39.78 37.37 1maj n ASN 58 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1maj s ARG 59 N 4.25 3.45 0.72 3.52 0.52 -1.26 -3.48 118.95 126.68 1maj s ARG 59 Ca 0.91 0.94 -0.11 0.00 -0.52 0.00 0.00 55.73 56.96 1maj s ARG 59 Cb -0.58 -2.06 0.02 0.00 0.52 0.00 0.00 34.95 32.85 1maj s ARG 59 CO 0.48 -0.69 1.07 0.12 0.02 0.00 0.00 175.30 176.30 1maj s PHE 60 N -2.87 2.96 -0.74 -0.53 5.36 0.10 -4.88 117.98 117.39 1maj s PHE 60 Ca 0.58 1.43 -0.26 0.00 -0.96 0.00 0.00 56.93 57.72 1maj s PHE 60 Cb -0.13 -2.94 -0.10 0.00 -0.34 0.00 0.00 43.02 39.52 1maj s PHE 60 CO 0.46 -1.41 2.29 0.45 -1.46 0.00 0.00 175.22 175.54 1maj s SER 61 N -3.71 4.31 0.00 6.13 0.15 -1.26 -1.18 113.70 118.14 1maj s SER 61 Ca 0.59 0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.37 1maj s SER 61 Cb -0.15 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1maj s SER 61 CO 0.55 -3.39 0.00 0.61 1.20 0.00 0.00 173.24 172.21 1maj n GLY 62 N 6.60 1.18 3.64 9.45 0.00 -1.26 -5.10 105.19 119.70 1maj n GLY 62 Ca 0.42 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 1maj n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maj s VAL 63 N -0.33 4.66 0.81 1.61 1.01 -0.33 -5.01 120.40 122.82 1maj s VAL 63 Ca 0.00 1.77 -0.13 0.00 0.00 0.00 0.00 61.98 63.61 1maj s VAL 63 Cb 0.00 -4.30 0.08 0.00 0.00 0.00 0.00 36.38 32.16 1maj s VAL 63 CO 0.00 -0.27 1.18 -2.65 0.00 0.00 0.00 175.10 173.36 1maj n PRO 64 N 6.44 0.17 0.31 2.72 -0.02 -1.26 -4.73 135.00 138.62 1maj n PRO 64 Ca 0.10 0.13 0.16 0.00 -2.02 0.00 0.00 63.50 61.87 1maj n PRO 64 Cb 0.47 -2.42 0.85 0.00 -0.02 0.00 0.00 33.50 32.38 1maj n PRO 64 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1maj h ASP 65 N -0.92 0.00 -0.67 2.55 3.58 -1.99 -1.84 116.42 117.12 1maj h ASP 65 Ca -0.46 0.00 0.19 0.00 0.42 0.00 0.00 57.03 57.18 1maj h ASP 65 Cb 1.30 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.32 1maj h ASP 65 CO 0.46 0.00 0.67 0.03 -2.88 0.00 0.00 179.24 177.52 1maj h ARG 66 N 0.00 0.00 -5.21 0.28 3.08 -1.96 -3.38 114.38 107.19 1maj h ARG 66 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1maj h ARG 66 Cb 0.49 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.41 1maj h ARG 66 CO 0.00 0.00 -0.51 -0.06 -1.07 0.00 0.00 179.97 178.33 1maj s PHE 67 N -4.64 3.35 -0.05 3.04 0.40 -0.69 -0.33 117.98 119.07 1maj s PHE 67 Ca -0.04 0.25 -0.02 0.00 -0.60 0.00 0.00 56.93 56.52 1maj s PHE 67 Cb 0.16 -2.19 0.04 0.00 0.51 0.00 0.00 43.02 41.54 1maj s PHE 67 CO 0.57 0.19 0.09 -1.54 0.70 0.00 0.00 175.22 175.24 1maj s SER 68 N 0.61 0.11 0.13 1.36 1.04 -0.43 -4.82 113.70 111.69 1maj s SER 68 Ca 0.07 0.18 0.10 0.00 0.48 0.00 0.00 55.95 56.78 1maj s SER 68 Cb -0.12 0.06 -0.04 0.00 0.10 0.00 0.00 66.02 66.02 1maj s SER 68 CO 0.00 -0.16 -0.20 -0.83 0.98 0.00 0.00 173.24 173.04 1maj s GLY 69 N 1.29 1.67 -0.14 7.32 0.00 -1.26 -0.72 107.32 115.48 1maj s GLY 69 Ca -0.07 -1.41 -0.29 0.00 0.00 0.00 0.00 44.72 42.95 1maj s GLY 69 CO -0.05 -1.39 0.82 -0.45 0.00 0.00 0.00 173.10 172.03 1maj s SER 70 N -2.20 -0.56 -0.29 1.64 0.15 -1.03 -3.28 113.70 108.14 1maj s SER 70 Ca 0.18 0.74 -0.15 0.00 0.70 0.00 0.00 55.95 57.41 1maj s SER 70 Cb -0.10 0.63 0.13 0.00 -1.71 0.00 0.00 66.02 64.97 1maj s SER 70 CO 0.09 -0.43 0.87 -0.83 1.20 0.00 0.00 173.24 174.14 1maj s GLY 71 N -0.79 -0.30 -1.17 9.45 0.00 -1.25 -1.67 107.32 111.58 1maj s GLY 71 Ca -0.05 2.84 -0.06 0.00 0.00 0.00 0.00 44.72 47.46 1maj s GLY 71 CO 0.04 2.79 1.79 1.44 0.00 0.00 0.00 173.10 179.17 1maj n SER 72 N 4.43 6.33 0.00 1.64 7.64 -1.18 -4.84 113.62 127.64 1maj n SER 72 Ca -0.15 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.41 1maj n SER 72 Cb 0.55 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1maj n SER 72 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1maj n GLY 73 N 1.67 1.98 0.00 0.23 0.00 -1.26 -4.60 105.19 103.21 1maj n GLY 73 Ca 0.38 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1maj n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1maj n THR 74 N 0.00 0.14 -3.53 2.61 -2.24 -1.26 -3.70 114.28 106.30 1maj n THR 74 Ca 0.00 -0.52 -0.41 0.00 -2.27 0.00 0.00 64.05 60.84 1maj n THR 74 Cb 0.00 1.01 -0.08 0.00 -2.10 0.00 0.00 70.33 69.16 1maj n THR 74 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1maj s ASP 75 N -0.14 5.81 0.07 3.42 -4.77 -1.26 -1.68 116.67 118.11 1maj s ASP 75 Ca 0.00 -2.10 0.07 0.00 -3.30 0.00 0.00 52.55 47.22 1maj s ASP 75 Cb 0.00 -2.03 -0.04 0.00 -1.09 0.00 0.00 42.92 39.76 1maj s ASP 75 CO 0.00 -0.66 -0.14 -0.36 0.70 0.00 0.00 175.17 174.71 1maj s PHE 76 N 1.08 2.66 -0.14 2.11 0.08 -0.69 -3.10 117.98 119.98 1maj s PHE 76 Ca 0.08 -0.19 -0.10 0.00 0.12 0.00 0.00 56.93 56.84 1maj s PHE 76 Cb -0.24 -1.45 0.05 0.00 -0.57 0.00 0.00 43.02 40.80 1maj s PHE 76 CO -0.02 0.35 0.35 0.99 -0.10 0.00 0.00 175.22 176.80 1maj s THR 77 N -1.07 -0.02 -0.40 0.64 2.01 -0.67 0.36 115.64 116.49 1maj s THR 77 Ca 0.18 0.07 -0.20 0.00 0.31 0.00 0.00 61.69 62.05 1maj s THR 77 Cb -0.11 -0.52 0.01 0.00 0.01 0.00 0.00 72.50 71.90 1maj s THR 77 CO 0.09 0.03 0.61 -0.22 -0.69 0.00 0.00 174.62 174.44 1maj s LEU 78 N 0.90 4.43 -0.17 4.42 0.20 0.13 -2.90 118.68 125.70 1maj s LEU 78 Ca -0.06 -0.18 -0.05 0.00 0.69 0.00 0.00 54.13 54.53 1maj s LEU 78 Cb -0.07 -2.70 -0.03 0.00 -0.43 0.00 0.00 46.19 42.96 1maj s LEU 78 CO -0.07 -0.67 0.00 -0.54 -0.29 0.00 0.00 176.35 174.79 1maj s LYS 79 N 2.68 3.77 -0.11 1.98 1.02 0.11 -1.22 119.74 127.96 1maj s LYS 79 Ca 0.22 -0.46 -0.02 0.00 0.02 0.00 0.00 55.97 55.74 1maj s LYS 79 Cb -0.15 -3.05 -0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1maj s LYS 79 CO 0.17 0.22 -0.05 0.42 -0.92 0.00 0.00 175.35 175.18 1maj s ILE 80 N 0.45 3.78 -0.42 2.17 1.01 -0.25 -1.32 121.20 126.63 1maj s ILE 80 Ca -0.01 -0.42 0.23 0.00 0.00 0.00 0.00 60.65 60.45 1maj s ILE 80 Cb -0.14 -2.61 0.22 0.00 0.01 0.00 0.00 42.46 39.95 1maj s ILE 80 CO 0.02 0.54 1.45 0.28 0.00 0.00 0.00 174.94 177.23 1maj h SER 81 N 6.03 0.00 -2.25 3.58 0.02 -0.99 -2.38 113.55 117.57 1maj h SER 81 Ca -0.39 -0.01 -0.39 0.00 -0.84 0.00 0.00 61.79 60.16 1maj h SER 81 Cb 1.19 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.38 1maj h SER 81 CO 0.58 0.01 -0.69 -0.13 -1.14 0.00 0.00 176.83 175.45 1maj s ARG 82 N -3.24 0.38 -0.23 3.45 0.52 -1.24 -4.46 118.95 114.13 1maj s ARG 82 Ca 0.05 -0.46 -0.29 0.00 -0.52 0.00 0.00 55.73 54.51 1maj s ARG 82 Cb 0.08 -0.81 -0.01 0.00 0.52 0.00 0.00 34.95 34.73 1maj s ARG 82 CO 0.70 -1.08 1.28 0.08 0.02 0.00 0.00 175.30 176.30 1maj s VAL 83 N 2.01 4.22 0.45 3.52 1.01 0.23 -4.87 120.40 126.98 1maj s VAL 83 Ca 0.12 1.44 0.06 0.00 0.00 0.00 0.00 61.98 63.59 1maj s VAL 83 Cb -0.15 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 1maj s VAL 83 CO -0.25 -0.30 0.14 -1.61 0.00 0.00 0.00 175.10 173.09 1maj s GLU 84 N 3.82 2.17 0.51 2.72 0.41 -1.26 0.21 118.70 127.28 1maj s GLU 84 Ca 0.55 -2.02 0.30 0.00 -0.41 0.00 0.00 54.97 53.39 1maj s GLU 84 Cb -0.19 -1.85 1.41 0.00 -1.78 0.00 0.00 34.13 31.72 1maj s GLU 84 CO 0.18 -0.21 1.84 0.00 -0.49 0.00 0.00 175.26 176.58 1maj h ALA 85 N 1.40 2.78 -0.32 5.21 0.00 -1.94 0.44 119.26 126.82 1maj h ALA 85 Ca -0.42 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.35 1maj h ALA 85 Cb 1.27 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1maj h ALA 85 CO 0.71 -1.09 -0.30 0.93 0.00 0.00 0.00 179.25 179.50 1maj h GLU 86 N 0.10 0.67 0.00 0.00 5.08 -1.98 -2.66 114.58 115.79 1maj h GLU 86 Ca 0.50 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1maj h GLU 86 Cb 1.81 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.04 1maj h GLU 86 CO -0.07 0.89 0.00 0.22 -1.00 0.00 0.00 179.01 179.05 1maj h ASP 87 N 0.57 0.00 -3.56 1.42 3.58 -0.49 -3.43 116.42 114.52 1maj h ASP 87 Ca 0.07 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 57.00 1maj h ASP 87 Cb 0.80 0.00 0.04 0.00 1.72 0.00 0.00 39.33 41.89 1maj h ASP 87 CO 0.07 0.00 0.63 -0.76 -2.88 0.00 0.00 179.24 176.30 1maj s LEU 88 N -4.58 4.43 0.00 2.28 1.43 -1.00 -4.88 118.68 116.37 1maj s LEU 88 Ca -0.03 2.46 0.00 0.00 -1.03 0.00 0.00 54.13 55.54 1maj s LEU 88 Cb 0.07 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.66 1maj s LEU 88 CO 0.21 -0.49 0.00 0.61 0.23 0.00 0.00 176.35 176.91 1maj n GLY 89 N 1.83 0.41 3.57 -3.19 0.00 -0.55 -4.48 105.19 102.78 1maj n GLY 89 Ca 0.04 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.96 1maj n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1maj s ILE 90 N -2.46 5.28 0.30 -0.61 -1.09 0.17 -0.95 121.20 121.84 1maj s ILE 90 Ca 0.00 0.11 -0.19 0.00 -2.23 0.00 0.00 60.65 58.34 1maj s ILE 90 Cb 0.00 -3.62 -0.09 0.00 -1.58 0.00 0.00 42.46 37.17 1maj s ILE 90 CO 0.00 0.14 0.78 -0.31 -1.23 0.00 0.00 174.94 174.33 1maj s TYR 91 N 1.81 3.49 0.16 3.97 1.51 0.66 -1.09 117.35 127.87 1maj s TYR 91 Ca 0.08 1.39 -0.02 0.00 -1.01 0.00 0.00 57.07 57.51 1maj s TYR 91 Cb -0.16 -2.65 -0.04 0.00 -0.11 0.00 0.00 41.96 39.01 1maj s TYR 91 CO 0.11 0.16 0.12 -0.06 -1.11 0.00 0.00 175.55 174.77 1maj s PHE 92 N -1.81 0.92 -0.29 2.71 0.08 -0.26 -1.22 117.98 118.10 1maj s PHE 92 Ca 0.51 -1.23 0.03 0.00 0.12 0.00 0.00 56.93 56.36 1maj s PHE 92 Cb -0.13 -0.45 0.18 0.00 -0.57 0.00 0.00 43.02 42.05 1maj s PHE 92 CO 0.19 -0.60 0.50 0.00 -0.10 0.00 0.00 175.22 175.20 1maj s SER 94 N 2.69 4.84 -0.21 0.00 1.04 0.15 -2.02 113.70 120.19 1maj s SER 94 Ca 0.11 0.19 -0.00 0.00 0.48 0.00 0.00 55.95 56.73 1maj s SER 94 Cb -0.12 -0.86 0.05 0.00 0.10 0.00 0.00 66.02 65.19 1maj s SER 94 CO -0.26 -1.52 -0.05 0.00 0.98 0.00 0.00 173.24 172.39 1maj s GLN 95 N -5.10 1.48 -0.87 4.02 -2.07 -1.19 -0.26 119.66 115.66 1maj s GLN 95 Ca 0.60 -0.76 -0.08 0.00 -1.82 0.00 0.00 55.36 53.31 1maj s GLN 95 Cb -0.10 -2.34 -0.15 0.00 -1.09 0.00 0.00 33.01 29.34 1maj s GLN 95 CO 0.43 -0.54 3.20 0.25 -1.32 0.00 0.00 175.29 177.31 1maj n THR 96 N 4.78 3.77 0.03 3.63 -2.24 -1.26 -3.90 114.28 119.10 1maj n THR 96 Ca -0.12 -2.25 0.00 0.00 -2.27 0.00 0.00 64.05 59.42 1maj n THR 96 Cb 0.46 -2.28 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 1maj n THR 96 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1maj n THR 97 N 2.89 0.25 -3.06 4.28 -1.04 -1.26 -4.89 114.28 111.45 1maj n THR 97 Ca 0.61 0.08 -0.19 0.00 -2.04 0.00 0.00 64.05 62.51 1maj n THR 97 Cb 0.54 -1.09 0.05 0.00 -1.82 0.00 0.00 70.33 68.01 1maj n THR 97 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1maj s HIS 98 N -2.00 1.59 -0.09 -1.42 3.76 -1.25 -5.07 115.29 110.81 1maj s HIS 98 Ca 0.00 -0.69 -0.06 0.00 -0.15 0.00 0.00 55.06 54.16 1maj s HIS 98 Cb 0.00 -2.22 0.03 0.00 1.11 0.00 0.00 32.58 31.50 1maj s HIS 98 CO 0.00 -1.04 0.22 0.08 -0.85 0.00 0.00 174.74 173.14 1maj s VAL 99 N -2.63 -0.02 0.30 -0.90 1.01 -1.26 -3.00 120.40 113.89 1maj s VAL 99 Ca 0.60 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 62.36 1maj s VAL 99 Cb -0.06 -0.32 -0.10 0.00 0.00 0.00 0.00 36.38 35.90 1maj s VAL 99 CO 0.38 0.03 1.20 -2.16 0.00 0.00 0.00 175.10 174.55 1maj s PRO 100 N 0.62 4.50 -0.08 2.72 0.04 -1.26 -4.88 135.00 136.67 1maj s PRO 100 Ca -0.04 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 1maj s PRO 100 Cb -0.06 -3.14 -0.06 0.00 0.04 0.00 0.00 34.50 31.29 1maj s PRO 100 CO -0.03 0.01 1.74 -1.25 0.04 0.00 0.00 177.00 177.51 1maj s PRO 101 N -1.50 4.04 0.84 0.56 0.04 -1.16 -4.86 135.00 132.95 1maj s PRO 101 Ca 0.47 2.16 -0.10 0.00 0.04 0.00 0.00 61.00 63.57 1maj s PRO 101 Cb -0.36 -4.05 0.10 0.00 0.04 0.00 0.00 34.50 30.23 1maj s PRO 101 CO 0.46 -1.02 1.11 0.95 0.04 0.00 0.00 177.00 178.53 1maj s THR 102 N 4.59 2.82 -0.41 1.26 -4.23 -1.26 -4.81 115.64 113.60 1maj s THR 102 Ca 0.78 0.27 0.04 0.00 -1.18 0.00 0.00 61.69 61.60 1maj s THR 102 Cb -0.34 -2.59 0.47 0.00 1.34 0.00 0.00 72.50 71.38 1maj s THR 102 CO 0.32 -0.35 1.51 0.33 -0.54 0.00 0.00 174.62 175.89 1maj n PHE 103 N -3.82 2.62 -1.09 3.99 7.35 -1.26 -3.19 117.46 122.05 1maj n PHE 103 Ca 0.10 -2.37 0.08 0.00 -0.76 0.00 0.00 57.45 54.50 1maj n PHE 103 Cb 0.53 -0.72 -0.02 0.00 0.35 0.00 0.00 39.48 39.62 1maj n PHE 103 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1maj n GLY 104 N -0.85 -2.04 0.11 7.13 0.00 -0.86 -3.57 105.19 105.11 1maj n GLY 104 Ca 0.48 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.94 1maj n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 105 N -2.27 -0.81 0.00 -0.02 0.00 -0.90 -4.84 105.19 96.35 1maj n GLY 105 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1maj n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 106 N 1.43 1.98 3.59 -0.02 0.00 -1.26 -4.87 105.19 106.04 1maj n GLY 106 Ca -0.33 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 1maj n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1maj s THR 107 N 0.00 5.26 -0.25 2.61 2.01 -0.36 -4.82 115.64 120.09 1maj s THR 107 Ca 0.00 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 1maj s THR 107 Cb 0.00 -3.49 0.01 0.00 0.01 0.00 0.00 72.50 69.02 1maj s THR 107 CO 0.00 0.27 1.13 -0.75 -0.69 0.00 0.00 174.62 174.58 1maj s LYS 108 N 1.64 4.16 -0.40 4.92 2.36 0.12 -0.24 119.74 132.30 1maj s LYS 108 Ca 0.07 1.33 -0.03 0.00 -2.55 0.00 0.00 55.97 54.79 1maj s LYS 108 Cb -0.16 -3.72 0.11 0.00 -1.05 0.00 0.00 37.83 33.01 1maj s LYS 108 CO 0.10 -0.78 0.19 -1.17 1.55 0.00 0.00 175.35 175.24 1maj s LEU 109 N 3.53 5.19 0.26 5.43 0.20 -0.12 0.96 118.68 134.13 1maj s LEU 109 Ca 0.48 -1.99 0.11 0.00 0.69 0.00 0.00 54.13 53.42 1maj s LEU 109 Cb -0.16 -1.82 -0.05 0.00 -0.43 0.00 0.00 46.19 43.73 1maj s LEU 109 CO 0.12 -0.53 -0.14 -1.83 -0.29 0.00 0.00 176.35 173.68 1maj s GLU 110 N 1.15 1.86 1.07 1.98 1.03 -1.21 -1.48 118.70 123.10 1maj s GLU 110 Ca 0.08 -1.63 -0.12 0.00 0.03 0.00 0.00 54.97 53.32 1maj s GLU 110 Cb -0.23 -1.90 0.23 0.00 -0.80 0.00 0.00 34.13 31.43 1maj s GLU 110 CO -0.04 0.35 1.06 -1.50 -1.33 0.00 0.00 175.26 173.80 1maj s ILE 111 N -2.35 2.09 0.45 1.83 2.07 -1.26 -1.58 121.20 122.44 1maj s ILE 111 Ca 0.29 0.03 -0.16 0.00 -1.41 0.00 0.00 60.65 59.40 1maj s ILE 111 Cb -0.06 -2.28 -0.09 0.00 0.13 0.00 0.00 42.46 40.16 1maj s ILE 111 CO 0.16 -0.04 0.91 -0.75 -1.91 0.00 0.00 174.94 173.31 1maj s LYS 112 N -4.70 4.00 0.00 3.50 2.36 0.49 -4.11 119.74 121.27 1maj s LYS 112 Ca 0.67 0.88 0.00 0.00 -2.55 0.00 0.00 55.97 54.97 1maj s LYS 112 Cb -0.22 -2.22 0.00 0.00 -1.05 0.00 0.00 37.83 34.34 1maj s LYS 112 CO 0.61 -0.12 0.00 -2.13 1.55 0.00 0.00 175.35 175.26